%chk=000098057.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000098057

0 1
 Cl   1.128600      -3.921500      -1.436800    
 O   0.6591000       1.735000      -2.076800    
 N    1.727000       1.062000     -0.1419000    
 N   -3.336200       1.315700      0.6365000    
 C  -0.7031000      0.8563000     -0.3317000    
 C   -1.820500       1.132300      -1.365300    
 C  -0.9186000       1.815300      0.8789000    
 C   0.6153000       1.263300     -0.9395000    
 C   -3.226100      0.9487000     -0.7756000    
 C   -2.361500       2.324000       1.022700    
 C  -0.6588000     -0.6455000     -6.8000001E-03
 C    3.072400       1.396700     -0.5853000    
 C    1.742900      0.5123000       1.210200    
 C    3.917100       1.329300      0.6776000    
 C    3.215400      0.2538000       1.497300    
 C   0.1238000      -1.499100     -0.7799000    
 C   -1.401400      -1.144600       1.060100    
 C   0.1641000      -2.861600     -0.4839000    
 C   -1.361100      -2.507000       1.356100    
 C  -0.5783000      -3.365500      0.5841000    
 H   -1.716900      0.4910000      -2.250800    
 H   -1.743600       2.167000      -1.730100    
 H  -0.2777000       2.705000      0.8125000    
 H  -0.6673000       1.324200       1.825000    
 H   -3.930900       1.547100      -1.365600    
 H   -3.542800     -9.4700001E-02 -0.8838000    
 H   -2.533100       2.616100       2.065000    
 H   -2.503700       3.231500      0.4223000    
 H    3.092100       2.379700      -1.064900    
 H    3.379100      0.6400000      -1.315900    
 H    1.186000     -0.3983000       1.385500    
 H    1.406900       1.292600       1.898800    
 H    3.874900       2.287200       1.209900    
 H    4.965200       1.095800      0.4720000    
 H    3.502200     -0.7379000       1.126600    
 H    3.454900      0.3055000       2.562900    
 H   -4.282200       1.637400      0.8356000    
 H   0.6867000      -1.137000      -1.636000    
 H   -2.003300     -0.5195000       1.706900    
 H   -1.934100      -2.898900       2.191400    
 H  -0.5554000      -4.424600      0.8274000    


%chk=000098057-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000098057

0 1
Cl 1.069528 -4.029180 -1.505289
O 0.777232 1.644890 -2.054691
N 1.790816 1.187794 -0.041029
N -3.408471 1.365767 0.579078
C -0.712537 0.851343 -0.234061
C -1.803790 1.117481 -1.322468
C -1.017397 1.770379 1.016156
C 0.668159 1.256816 -0.843079
C -3.236066 0.847034 -0.806943
C -2.430546 2.399385 0.968608
C -0.714404 -0.666084 0.078509
C 3.120784 1.532780 -0.625359
C 1.916373 0.707715 1.361379
C 4.103735 1.367763 0.558457
C 3.408856 0.321628 1.467678
C 0.072440 -1.542203 -0.719287
C -1.550070 -1.227276 1.078978
C 0.032663 -2.925279 -0.475018
C -1.572467 -2.622442 1.301412
C -0.771074 -3.495093 0.530022
H -1.603104 0.492706 -2.208888
H -1.699997 2.163757 -1.659039
H -0.275723 2.590942 1.062131
H -0.914502 1.186199 1.947476
H -3.948510 1.314941 -1.524238
H -3.439623 -0.241943 -0.809828
H -2.695021 2.773492 1.975512
H -2.424893 3.286355 0.288417
H 3.101564 2.552383 -1.047417
H 3.345308 0.841180 -1.459803
H 1.238229 -0.139044 1.554467
H 1.672894 1.519778 2.076162
H 4.216051 2.325243 1.100313
H 5.104039 1.048065 0.222003
H 3.563697 -0.696844 1.066338
H 3.772059 0.342098 2.509190
H -4.378372 1.618148 0.796744
H 0.702897 -1.148096 -1.523161
H -2.218153 -0.567488 1.643591
H -2.226227 -3.040001 2.075215
H -0.779278 -4.575991 0.696466


